[2-[[(2R)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 4-[(4-ethoxyphenyl)sulfonylamino]benzoate

Systemtic Name: [2-[[(2R)-butan-2-yl]amino]-2-oxidanylidene-ethyl] 4-[(4-ethoxyphenyl)sulfonylamino]benzoate Openeye Name: [2-[[(1R)-1-methylpropyl]amino]-2-oxo-ethyl] 4-[(4-ethoxyphenyl)sulfonylamino]benzoate CAS Name: 4-[(4-ethoxyphenyl)sulfonylamino]benzoic acid [2-[[(2R)-butan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2R)-butan-2-yl]amino]-2-oxoethyl] 4-[(4-ethoxyphenyl)sulfonylamino]benzoate Traditional Name: 4-(p-phenetylsulfonylamino)benzoic acid [2-keto-2-[[(1R)-1-methylpropyl]amino]ethyl] ester Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

CC[C@@H](C)NC(=O)COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C21H26N2O6S/c1-4-15(3)22-20(24)14-29-21(25)16-6-8-17(9-7-16)23-30(26,27)19-12-10-18(11-13-19)28-5-2/h6-13,15,23H,4-5,14H2,1-3H3,(H,22,24)/t15-/m1/s1